SCHEMBL4355660

SCHEMBL4355660

Cc1cccc(Nc2ncnc3ccc(CSc4nc5ccccc5[nH]4)cc23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.55
HTT P42858 3/20 0.54
HIF1A Q16665 1/20 0.54
ERBB2 P04626 3/20 0.53
MAPK1 P28482 3/20 0.53
MET P08581 3/20 0.52
KDR P35968 3/20 0.52
MPO P05164 1/20 0.51
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KDM4E B2RXH2 1/20 0.48
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
TP53 P04637 1/20 0.48
MEN1 O00255 1/20 0.47
GALR3 O60755 1/20 0.47
MAPT P10636 1/20 0.47
STAT3 P40763 1/20 0.47
KMT2A Q03164 1/20 0.47
RECQL P46063 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6190034 0.84 EGFR (0.55) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL8871898 0.82 EGFR (0.61) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL8871855 0.80 EGFR (0.66) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL8782001 0.79 KDR (0.74) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL4360006 0.78 EGFR (0.55) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL15652863 0.77 RAB9A (0.71) HTTMAPK1MPOLMNASMN1; SMN2
SCHEMBL6190374 0.76 EGFR (0.54) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL8872022 0.75 EGFR (0.60) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL6188219 0.75 MAPK1 (0.73) EGFRHTTHIF1AERBB2MAPK1
SCHEMBL8871877 0.75 EGFR (0.65) EGFRHTTHIF1AERBB2MAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009070328-A1 MODULATORS OF THE EPIDERMAL GROWTH FACTOR RECEPTOR (EGFR) PATHWAY FOR USE IN THE TREATMENT OR PREVENTION OF SUBSTANCE ABUSE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-06-04 WO disclosed
US-6897214-B2 Quinazoline derivatives ZENECA LIMITED (GB) 2005-05-24 US disclosed
EP-0880507-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2005-04-13 EP disclosed
US-20030018029-A1 Quinazoline derivatives ZENECA LIMITED 2003-01-23 US disclosed
US-6399602-B1 ANTICANCER AGENTS ZENECA LIMITED (GB) 2002-06-04 US disclosed
US-5866572-A RECEPTOR TYROSINE KINASE INHIBITORY PROPERTIES, TREATMENT OF PROLIFERATIVE DISEASES SUCH AS CANCER. ZENECA LIMITED (GB) 1999-02-02 US disclosed
EP-0880507-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
WO-1997030034-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1997-08-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030018029-A1 Quinazoline derivatives ABL1, FGFR1, ERBB2 EGFR 25/4885HTT 2841/4885HIF1A 1922/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.